(2S,3R,4R)-2-[(Dodecyloxy)Carbonyl]-4-Hydroxy-5-Oxotetrahydro-3-Furancarboperoxoic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C18H30O8
IUPAC Name (2s,3r,4r)-2-dodecoxycarbonyl-4-hydroxy-5-oxo-tetrahydrofuran-3-carboperoxoic acid
Molecular Mass 374.426 g·mol−1
Heat of Formation -1331.0 ± 16.7 kJ·mol−1
Dipole Moment 3.96 ± 1.08 D
Volume 465.2 Å 3
Surface Area 422.32 Å 2
HOMO Energy -10.98 ± 0.55 eV
LUMO Energy -0.41 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r,4r)-2-(dodecoxy-oxomethyl)-4-hydroxy-5-oxo-3-tetrahydrofurancarboperoxoic acid
  • (2s,3r,4r)-2-dodecoxycarbonyl-4-hydroxy-5-oxo-oxolane-3-carboperoxoic acid
  • (2s,3r,4r)-2-dodecoxycarbonyl-4-hydroxy-5-oxo-tetrahydrofuran-3-carboperoxoic acid
  • (2s,3r,4r)-2-dodecoxycarbonyl-4-hydroxy-5-oxooxolane-3-carboperoxoic acid
  • (2s,3r,4r)-4-hydroxy-5-keto-2-lauryloxycarbonyl-tetrahydrofuran-3-carboperoxoic acid
  • 2,3-furandicarboxylic acid, 2-dodecyltetrahydro-3,4-dihydroxy-5-oxo-, (2s-(2alpha,3alpha,4beta))-
  • cinatrin c1
CAS Number(s)
  • 136266-35-8
InChIKey YYAODTFONAOLHT-KFWWJZLASA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O